Ethylene glycol mono-n-butyl ether
PubChem CID: 8133
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| Compound Synonyms | 2-Butoxyethanol, 111-76-2, Butoxyethanol, Butyl glycol, Butyl cellosolve, ETHYLENE GLYCOL MONOBUTYL ETHER, n-Butoxyethanol, Ethylene glycol butyl ether, Ethanol, 2-butoxy-, Butyl oxitol, Dowanol EB, 2-butoxyethan-1-ol, Glycol butyl ether, Glycol ether eb, 3-Oxa-1-heptanol, Gafcol EB, 2-Butoxy-1-ethanol, 2-n-Butoxyethanol, Jeffersol eb, Butyl cellu-sol, O-Butyl ethylene glycol, Ektasolve EB, EGBE, Chimec NR, Glycol monobutyl ether, 2-Butoxy ethanol, 2-Butossi-etanolo, 2-Butoxy-aethanol, Butylcelosolv, Butylglycol, BUCS, Butoksyetylowy alkohol, Ethylene glycol n-butyl ether, EGMBE, Monobutyl glycol ether, 2-Butoxy-ethanol, Monobutyl ether of ethylene glycol, Ethylene glycol mono-n-butyl ether, n-Butyl Cellosolve, butylcellosolve, 9004-77-7, Butyl monoether glycol, Butylcelosolv [Czech], Caswell No. 121, beta-Butoxyethanol, Monobutyl ethylene glycol ether, Minex BDH, Ethylene glycol, monobutyl ether, .beta.-Butoxyethanol, Butylglycol [French,German], 2-Butoxy-aethanol [German], ethyleneglycol monobutyl ether, 2-Hydroxyethyl n-butyl ether, 2-Butossi-etanolo [Italian], 2-Butoxyethan(ol-d), NSC 60759, Butyglycol, CCRIS 5985, HSDB 538, Glycol ether eb acetate, 2-n-Butoxy-1-ethanol, Butoksyetylowy alkohol [Polish], Ether alcohol, Butyl icinol, Eter monobutilico del etilenglicol, I0P9XEZ9WV, EINECS 203-905-0, UN2369, EPA Pesticide Chemical Code 011501, Ether monobutylique de l'ethyleneglycol, BRN 1732511, 2-Butoxyethanol (ethylene glycol monobutyl ether), AI3-0993, DTXSID1024097, CHEBI:63921, AI3-09903, BuOCH2CH2OH, Eter monobutilico del etilenglicol [Spanish], NSC-60759, Ether monobutylique de l'ethyleneglycol [French], Butyl 2-hydroxyethyl ether, BUTYL CELLOSOLVE [MI], DTXCID904097, 2-BUTOXYETHANOL [IARC], 2-BUTOXYETHANOL [VANDF], EC 203-905-0, EC 500-012-0, 2-BUTOXY(ETHANOL-13C2), Butylcelosolv (Czech), Butylglycol (French,German), ETHYLENE GLYCOL MONO-N-BUTYL ETHER [HSDB], Ethyleneglycol-monobutyl ether, 2-BUTOXYETHANOL (IARC), 2-BUTOXY-AETHANOL (GERMAN), 2-BUTOSSI-ETANOLO (ITALIAN), g lycol ether eb, BUTOKSYETYLOWY ALKOHOL (POLISH), 2 -Butoxyethanol, CAS-111-76-2, SMR001253761, Butoxyethanol, 2-, Ektasolve EB solvent, Eter monobutilico del etilenglicol (Spanish), Ek tasolve EB solvent, Ether monobutylique de L'ethyleneglycol (French), UNII-I0P9XEZ9WV, n-butoxyethanol sodium salt, Butyloxitol, nButoxyethanol, 2butoxyethanol, Butyl cellusol, 2Butoxy1ethanol, 3Oxa1heptanol, Ethylene glycol mono butyl ether, EB Solvent, PolySolv EB, Ethanol, 2butoxy, 3-oxaheptan-1-ol, Caswell No 121, 2-(n-Butoxy)ethanol, OButyl ethylene glycol, GLYCOL EB, Butyl cellosolve (OSHA), 2-(1-Butyloxy) ethanol, Ethylene glycol nbutyl ether, Aethylenglycolmonobuthylaether, BUTOXYETHANOL [INCI], 2-Butoxy-aethanol(GERMAN), SCHEMBL15712, MLS002174253, MLS002454362, WLN: Q2O4, Butyglycol(FRENCH, GERMAN), Ethylene glycol monobutyl ether (EGBE)(2-Butoxyet), ethylene glycol-monobutyl ether, ETHYLENE GLYCOL N-BUTYL, CHEMBL284588, QSPL 003, 2-Butoxyethanol (ACGIH:OSHA), 2-BUTOXY ETHANOL (ETHYLENE GLYCOL MONOBUTYL ETHER), Ethylene glycol butyl ether, 99%, 2-butoxyethanol (butyl cellosolve), NSC60759, Tox21_202399, Tox21_300123, BUTYLGLYCOL (FRENCH, GERMAN), MFCD00002884, Ethylene glycol butyl ether, >=99%, AKOS009028760, USEPA/OPP Pesticide Code: 011501, NCGC00090683-01, NCGC00090683-02, NCGC00090683-03, NCGC00090683-04, NCGC00090683-05, NCGC00254083-01, NCGC00259948-01, LS-13220, B0698, NS00003129, EN300-19317, C19355, Ethylene glycol butyl ether, analytical standard, Q421557, A13-0993, Ethylene glycol butyl ether, for synthesis, 99.0%, Ethylene glycol butyl ether, SAJ first grade, >=99.0%, Ethylene glycol butyl ether, spectrophotometric grade, >=99.0%, Ethylene glycol monobutyl ether [UN2369] [Keep away from food], 203-905-0, 500-012-0, 686-062-5, 937-444-8 |
|---|---|
| Ghose Rule | False |
| Classyfire Kingdom | Organic compounds |
| Topological Polar Surface Area | 29.5 |
| Hydrogen Bond Donor Count | 1.0 |
| Pfizer 3 75 Rule | False |
| Np Classifier Class | Fatty alcohols |
| Deep Smiles | CCCCOCCO |
| Heavy Atom Count | 8.0 |
| Classyfire Class | Organooxygen compounds |
| Description | It is used in food processing as a processing aid, sanitizer, solvent, etc 2-Butoxyethanol is an organic solvent with the formula C6H14O2. It is a colorless liquid with a sweet, ether-like odour. It is a butyl ether of ethylene glycol, but should not be confused with it., The main use of 2-butoxyethanol is as a solvent in paints and surface coatings, followed by cleaning products and inks. Other products which contain 2-butoxyethanol include acrylic resin formulations, asphalt release agents, firefighting foam, leather protectors, oil spill dispersants, bowling pin and lane degreaser, and photographic strip solutions. 2-Butoxyethanol is a primary ingredient of various whiteboard cleaners, liquid soaps, cosmetics, dry cleaning solutions, lacquers, varnishes, herbicides, and latex paints. It also seems to be excellent at killing most insects and arachnids. |
| Classyfire Subclass | Ethers |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 37.5 |
| Database Name | cmaup_ingredients;fooddb_chem_all;hmdb_chem_all;imppat_phytochem;npass_chem_all;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Uniprot Id | P16473, P04150, Q9R1A7 |
| Iupac Name | 2-butoxyethanol |
| Prediction Hob | 1.0 |
| Class | Ethers |
| Veber Rule | True |
| Classyfire Superclass | Organic oxygen compounds |
| Target Id | NPT210 |
| Xlogp | 0.8 |
| Superclass | Organooxygen compounds |
| Subclass | Dialkyl ethers |
| Gsk 4 400 Rule | True |
| Molecular Formula | C6H14O2 |
| Prediction Swissadme | 0.0 |
| Inchi Key | POAOYUHQDCAZBD-UHFFFAOYSA-N |
| Silicos It Class | Soluble |
| Fcsp3 | 1.0 |
| Logs | 0.0 |
| Rotatable Bond Count | 5.0 |
| State | Liquid |
| Logd | 0.813 |
| Synonyms | &beta, -butoxyethanol, 2-Butossi-etanolo, 2-Butoxy ethanol, 2-BUTOXY ETHANOL (ETHYLENE GLYCOL MONOBUTYL ETHER), 2-Butoxy-1-ethanol, 2-Butoxy-aethanol, 2-Butoxy-aethanol(GERMAN), 2-Butoxy-ethanol, 2-Butoxyethan-1-ol, 2-butoxyethanol (butyl cellosolve), 2-Butoxyethanol (ethylene glycol monobutyl ether), 2-Hydroxyethyl n-butyl ether, 2-n-Butoxy-1-ethanol, 2-n-Butoxyethanol, 3-Oxa-1-heptanol, Beta-butoxyethanol, BUCS, BuOCH2CH2OH, Butoksyetylowy alkohol, Butoxyethanol, Butoxyethanol, 2-, Butyglycol, Butyl 2-hydroxyethyl ether, Butyl cellosolve, Butyl cellu-sol, Butyl glycol, Butyl icinol, Butyl monoether glycol, Butyl oxitol, Butylcellosolve, Butylcelosolv, Butylglycol, Butyloxitol, Chimec NR, Dowanol eb, Eb solvent, EGBE, Egmbe, Ek tasolve eb solvent, Ektasolve eb, Ektasolve eb solvent, Eter monobutilico del etilenglicol, Ethanol, 2-butoxy-, Ether alcohol, Ether monobutylique de l'ethyleneglycol, Ethylene glycol butyl ether, Ethylene glycol mono butyl ether, Ethylene glycol mono-n-butyl ether, Ethylene glycol monobutyl ether, Ethylene glycol monobutyl ether (EGBE)(2-Butoxyet), Ethylene glycol n-butyl ether, Ethylene glycol, monobutyl ether, Ethyleneglycol monobutyl ether, G lycol ether eb, Gafcol eb, Glycol butyl ether, Glycol ether eb, Glycol ether eb acetate, Glycol monobutyl ether, Jeffersol eb, Minex BDH, Monobutyl ether of ethylene glycol, Monobutyl ethylene glycol ether, Monobutyl glycol ether, N-butoxyethanol, N-butoxyethanol sodium salt, N-butyl cellosolve, O-butyl ethylene glycol, Poly-solv eb, 2-Hydroxyethyl N-butyl ether, BuOCH2ch2oh, Ethylene glycol mono-N-butyl ether, N-Butoxyethanol, O-Butyl ethylene glycol, 2-BUTOXY ethanol (ethylene glycol monobutyl ether), 2-Butoxyethanol (butyl cellosolve), 2-N-Butoxy-1-ethanol, 2-N-Butoxyethanol, beta-Butoxyethanol, Ethylene glycol monobutyl ether (egbe)(2-butoxyet), Ethylene glycol N-butyl ether, g Lycol ether eb, Monobutyl ether OF ethylene glycol, N-Butoxyethanol sodium salt, N-Butyl cellosolve, 2-butoxyethanol, ethanol, 2-butoxy |
| Substituent Name | Dialkyl ether, Hydrocarbon derivative, Primary alcohol, Alcohol, Aliphatic acyclic compound |
| Esol Class | Very soluble |
| Functional Groups | CO, COC |
| Compound Name | Ethylene glycol mono-n-butyl ether |
| Kingdom | Organic compounds |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 118.099 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 118.099 |
| Hydrogen Bond Acceptor Count | 2.0 |
| Molecular Weight | 118.17 |
| Gi Absorption | True |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Molecular Framework | Aliphatic acyclic compounds |
| Lipinski Rule Of 5 | True |
| Esol | -0.7655911999999998 |
| Inchi | InChI=1S/C6H14O2/c1-2-3-5-8-6-4-7/h7H,2-6H2,1H3 |
| Smiles | CCCCOCCO |
| Nring | 0.0 |
| Np Classifier Biosynthetic Pathway | Fatty acids |
| Defined Bond Stereocenter Count | 0.0 |
| Egan Rule | True |
| Taxonomy Direct Parent | Dialkyl ethers |
| Np Classifier Superclass | Fatty acyls |
- 1. Outgoing r'ship
FOUND_INto/from Allamanda Cathartica (Plant) Rel Props:Reference:https://doi.org/10.1080/0972060x.2012.10644013 - 2. Outgoing r'ship
FOUND_INto/from Chaenomeles Sinensis (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 3. Outgoing r'ship
FOUND_INto/from Ilex Paraguariensis (Plant) Rel Props:Reference:ISBN:9788172362300 - 4. Outgoing r'ship
FOUND_INto/from Persicaria Hydropiper (Plant) Rel Props:Reference:https://doi.org/10.1002/ffj.1363 - 5. Outgoing r'ship
FOUND_INto/from Psidium Guajava (Plant) Rel Props:Reference:https://doi.org/10.1080/10412905.2009.9700131